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#$Date: 2016-03-26 13:44:51 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180234 $
#$URL: svn://www.crystallography.net/cod/cif/7/11/20/7112019.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7112019
loop_
_publ_author_name
'Terrance J. Hadlington'
'Cameron Jones'
_publ_section_title
;
 A singly bonded amido-distannyne: H2 activation and isocyanide
 coordination
;
_journal_name_full               Chem.Commun.
_journal_page_first              2321
_journal_paper_doi               10.1039/c3cc49651a
_journal_volume                  50
_journal_year                    2014
_chemical_formula_sum            'C116 H164 N4 Si2 Sn2'
_chemical_formula_weight         1908.07
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 91.274(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   17.5664(8)
_cell_length_b                   13.8316(5)
_cell_length_c                   21.8305(12)
_cell_measurement_temperature    123(2)
_cell_volume                     5302.9(4)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      123(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker Apex X8'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0961
_diffrn_reflns_av_sigmaI/netI    0.0765
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_number            72060
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         2.92
_exptl_absorpt_coefficient_mu    0.541
_exptl_absorpt_correction_T_max  0.923
_exptl_absorpt_correction_T_min  0.871
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Sortav, Blessing 1995'
_exptl_crystal_colour            'orange green'
_exptl_crystal_density_diffrn    1.195
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2032
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.728
_refine_diff_density_min         -0.870
_refine_diff_density_rms         0.118
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.048
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     539
_refine_ls_number_reflns         12152
_refine_ls_number_restraints     33
_refine_ls_restrained_S_all      1.066
_refine_ls_R_factor_all          0.0981
_refine_ls_R_factor_gt           0.0598
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0750P)²+9.5215P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1438
_refine_ls_wR_factor_ref         0.1709
_reflns_number_gt                8304
_reflns_number_total             12152
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3cc49651a.txt
_cod_data_source_block           compound3
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7112019
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Sn1 Sn 0.558294(16) 0.075697(19) 0.979512(13) 0.02161(10) Uani 1 1 d . . .
Si1 Si 0.54604(7) 0.24872(8) 1.08846(6) 0.0221(3) Uani 1 1 d . . .
N1 N 0.5981(2) 0.1490(2) 1.06386(16) 0.0207(7) Uani 1 1 d . . .
C1 C 0.6728(2) 0.1220(3) 1.08579(19) 0.0210(9) Uani 1 1 d . . .
N2 N 0.7134(2) -0.0769(3) 0.98302(19) 0.0316(9) Uani 1 1 d . . .
C2 C 0.6834(2) 0.0533(3) 1.1340(2) 0.0224(9) Uani 1 1 d . . .
C3 C 0.7565(3) 0.0283(3) 1.1545(2) 0.0292(10) Uani 1 1 d . . .
H3 H 0.7617 -0.0174 1.1868 0.035 Uiso 1 1 calc R . .
C4 C 0.8217(3) 0.0667(3) 1.1300(2) 0.0308(11) Uani 1 1 d . B .
C5 C 0.8113(3) 0.1312(3) 1.0814(2) 0.0310(11) Uani 1 1 d . . .
H5 H 0.8551 0.1572 1.0626 0.037 Uiso 1 1 calc R . .
C6 C 0.7399(2) 0.1592(3) 1.0592(2) 0.0241(9) Uani 1 1 d . . .
C7 C 0.9007(3) 0.0390(4) 1.1555(3) 0.0564(17) Uani 1 1 d D . .
H7 H 0.8976 0.0583 1.1996 0.068 Uiso 1 1 calc R A 1
C8 C 0.9102(5) -0.0710(5) 1.1598(4) 0.048(3) Uani 0.661(11) 1 d PD B 1
H8A H 0.9156 -0.0979 1.1186 0.072 Uiso 0.661(11) 1 calc PR B 1
H8B H 0.8654 -0.0993 1.1788 0.072 Uiso 0.661(11) 1 calc PR B 1
H8C H 0.9558 -0.0862 1.1847 0.072 Uiso 0.661(11) 1 calc PR B 1
C9 C 0.9666(5) 0.0955(9) 1.1347(6) 0.075(4) Uani 0.661(11) 1 d PDU B 1
H9A H 0.9554 0.1647 1.1380 0.112 Uiso 0.661(11) 1 calc PR B 1
H9B H 0.9766 0.0795 1.0919 0.112 Uiso 0.661(11) 1 calc PR B 1
H9C H 1.0115 0.0798 1.1602 0.112 Uiso 0.661(11) 1 calc PR B 1
C10 C 0.6169(3) 0.0048(3) 1.1661(2) 0.0299(10) Uani 1 1 d . . .
H10 H 0.5712 0.0113 1.1382 0.036 Uiso 1 1 calc R . .
C11 C 0.6309(3) -0.1039(3) 1.1753(2) 0.0284(10) Uani 1 1 d . . .
C12 C 0.6221(3) -0.1667(3) 1.1258(2) 0.0358(12) Uani 1 1 d . . .
H12 H 0.6058 -0.1423 1.0871 0.043 Uiso 1 1 calc R . .
C13 C 0.6369(3) -0.2647(4) 1.1325(2) 0.0443(14) Uani 1 1 d . . .
H13 H 0.6304 -0.3068 1.0984 0.053 Uiso 1 1 calc R . .
C14 C 0.6612(3) -0.3017(3) 1.1887(3) 0.0409(13) Uani 1 1 d . . .
H14 H 0.6718 -0.3687 1.1932 0.049 Uiso 1 1 calc R . .
C15 C 0.6697(3) -0.2402(3) 1.2381(2) 0.0392(13) Uani 1 1 d . . .
H15 H 0.6858 -0.2649 1.2768 0.047 Uiso 1 1 calc R . .
C16 C 0.6548(3) -0.1421(3) 1.2312(2) 0.0347(12) Uani 1 1 d . . .
H16 H 0.6610 -0.1004 1.2655 0.042 Uiso 1 1 calc R . .
C17 C 0.5970(3) 0.0521(4) 1.2269(3) 0.0397(13) Uani 1 1 d . . .
C18 C 0.5273(4) 0.0317(5) 1.2529(3) 0.0569(17) Uani 1 1 d . . .
H18 H 0.4937 -0.0135 1.2339 0.068 Uiso 1 1 calc R . .
C19 C 0.5064(5) 0.0780(6) 1.3074(4) 0.076(3) Uani 1 1 d . . .
H19 H 0.4584 0.0642 1.3247 0.091 Uiso 1 1 calc R . .
C20 C 0.5552(6) 0.1435(6) 1.3360(4) 0.082(3) Uani 1 1 d . . .
H20 H 0.5402 0.1763 1.3720 0.098 Uiso 1 1 calc R . .
C21 C 0.6246(5) 0.1602(4) 1.3121(3) 0.064(2) Uani 1 1 d . . .
H21 H 0.6592 0.2027 1.3326 0.077 Uiso 1 1 calc R . .
C22 C 0.6458(4) 0.1155(4) 1.2579(2) 0.0440(14) Uani 1 1 d . . .
H22 H 0.6945 0.1286 1.2417 0.053 Uiso 1 1 calc R . .
C23 C 0.7374(3) 0.2315(3) 1.0058(2) 0.0286(10) Uani 1 1 d . . .
H23 H 0.6829 0.2366 0.9919 0.034 Uiso 1 1 calc R . .
C24 C 0.7633(3) 0.3344(3) 1.0233(2) 0.0294(10) Uani 1 1 d . . .
C25 C 0.8016(3) 0.3585(3) 1.0778(2) 0.0346(11) Uani 1 1 d . . .
H25 H 0.8154 0.3091 1.1061 0.041 Uiso 1 1 calc R . .
C26 C 0.8197(3) 0.4546(4) 1.0911(3) 0.0423(13) Uani 1 1 d . . .
H26 H 0.8454 0.4702 1.1286 0.051 Uiso 1 1 calc R . .
C27 C 0.8004(3) 0.5275(4) 1.0499(3) 0.0472(14) Uani 1 1 d . . .
H27 H 0.8123 0.5930 1.0592 0.057 Uiso 1 1 calc R . .
C28 C 0.7642(3) 0.5045(4) 0.9956(3) 0.0452(14) Uani 1 1 d . . .
H28 H 0.7513 0.5542 0.9671 0.054 Uiso 1 1 calc R . .
C29 C 0.7459(3) 0.4088(3) 0.9820(3) 0.0363(12) Uani 1 1 d . . .
H29 H 0.7213 0.3938 0.9440 0.044 Uiso 1 1 calc R . .
C30 C 0.7821(3) 0.1968(3) 0.9502(2) 0.0333(11) Uani 1 1 d . . .
C31 C 0.8595(3) 0.2137(4) 0.9444(3) 0.0449(13) Uani 1 1 d . . .
H31 H 0.8862 0.2485 0.9757 0.054 Uiso 1 1 calc R . .
C32 C 0.8990(3) 0.1805(4) 0.8935(3) 0.0516(15) Uani 1 1 d . . .
H32 H 0.9522 0.1917 0.8908 0.062 Uiso 1 1 calc R . .
C33 C 0.8610(4) 0.1321(4) 0.8475(3) 0.0540(16) Uani 1 1 d . . .
H33 H 0.8877 0.1089 0.8131 0.065 Uiso 1 1 calc R . .
C34 C 0.7831(4) 0.1172(4) 0.8515(3) 0.0505(15) Uani 1 1 d . . .
H34 H 0.7561 0.0853 0.8192 0.061 Uiso 1 1 calc R . .
C35 C 0.7446(3) 0.1489(4) 0.9025(2) 0.0385(12) Uani 1 1 d . . .
H35 H 0.6915 0.1376 0.9049 0.046 Uiso 1 1 calc R . .
C36 C 0.4832(3) 0.2143(3) 1.1537(2) 0.0265(10) Uani 1 1 d . . .
H36 H 0.5182 0.1821 1.1841 0.032 Uiso 1 1 calc R . .
C37 C 0.4433(3) 0.2933(4) 1.1903(2) 0.0383(12) Uani 1 1 d . . .
H37A H 0.4074 0.3280 1.1633 0.057 Uiso 1 1 calc R . .
H37B H 0.4814 0.3387 1.2069 0.057 Uiso 1 1 calc R . .
H37C H 0.4158 0.2637 1.2240 0.057 Uiso 1 1 calc R . .
C38 C 0.4252(3) 0.1353(3) 1.1348(2) 0.0330(11) Uani 1 1 d . . .
H38A H 0.4003 0.1106 1.1714 0.049 Uiso 1 1 calc R . .
H38B H 0.4517 0.0823 1.1144 0.049 Uiso 1 1 calc R . .
H38C H 0.3868 0.1629 1.1067 0.049 Uiso 1 1 calc R . .
C39 C 0.4851(3) 0.2896(3) 1.0196(2) 0.0257(10) Uani 1 1 d . . .
H39 H 0.4627 0.2296 1.0010 0.031 Uiso 1 1 calc R . .
C40 C 0.4176(3) 0.3550(4) 1.0358(2) 0.0356(12) Uani 1 1 d . . .
H40A H 0.4364 0.4113 1.0589 0.053 Uiso 1 1 calc R . .
H40B H 0.3818 0.3187 1.0608 0.053 Uiso 1 1 calc R . .
H40C H 0.3917 0.3768 0.9981 0.053 Uiso 1 1 calc R . .
C41 C 0.5333(3) 0.3374(3) 0.9692(2) 0.0327(11) Uani 1 1 d . . .
H41A H 0.5001 0.3552 0.9343 0.049 Uiso 1 1 calc R . .
H41B H 0.5721 0.2917 0.9556 0.049 Uiso 1 1 calc R . .
H41C H 0.5582 0.3955 0.9858 0.049 Uiso 1 1 calc R . .
C42 C 0.6110(3) 0.3510(3) 1.1144(2) 0.0263(10) Uani 1 1 d . . .
H42 H 0.6513 0.3555 1.0829 0.032 Uiso 1 1 calc R . .
C43 C 0.6531(3) 0.3291(3) 1.1749(2) 0.0329(11) Uani 1 1 d . . .
H43A H 0.6874 0.3828 1.1853 0.049 Uiso 1 1 calc R . .
H43B H 0.6828 0.2696 1.1706 0.049 Uiso 1 1 calc R . .
H43C H 0.6161 0.3209 1.2074 0.049 Uiso 1 1 calc R . .
C44 C 0.5751(3) 0.4527(3) 1.1175(2) 0.0375(12) Uani 1 1 d . . .
H44A H 0.5365 0.4536 1.1493 0.056 Uiso 1 1 calc R . .
H44B H 0.5511 0.4685 1.0778 0.056 Uiso 1 1 calc R . .
H44C H 0.6147 0.5004 1.1274 0.056 Uiso 1 1 calc R . .
C45 C 0.6586(3) -0.0331(3) 0.9900(2) 0.0277(10) Uani 1 1 d . . .
C46 C 0.7845(3) -0.1309(3) 0.9742(2) 0.0415(14) Uani 1 1 d D . .
C47 C 0.8499(3) -0.0607(4) 0.9740(3) 0.0517(16) Uani 1 1 d D . .
H47A H 0.8428 -0.0150 0.9401 0.078 Uiso 1 1 calc R . .
H47B H 0.8977 -0.0962 0.9689 0.078 Uiso 1 1 calc R . .
H47C H 0.8519 -0.0253 1.0129 0.078 Uiso 1 1 calc R . .
C48 C 0.7789(5) -0.1789(7) 0.9116(4) 0.104(3) Uani 1 1 d DU . .
H48A H 0.7413 -0.2311 0.9126 0.156 Uiso 1 1 calc R . .
H48B H 0.8287 -0.2056 0.9012 0.156 Uiso 1 1 calc R . .
H48C H 0.7633 -0.1309 0.8808 0.156 Uiso 1 1 calc R . .
C49 C 0.7919(5) -0.2028(6) 1.0253(4) 0.093(3) Uani 1 1 d DU . .
H49A H 0.7950 -0.1686 1.0646 0.140 Uiso 1 1 calc R . .
H49B H 0.8382 -0.2412 1.0201 0.140 Uiso 1 1 calc R . .
H49C H 0.7475 -0.2457 1.0246 0.140 Uiso 1 1 calc R . .
C50 C 0.5593(7) 0.2339(7) 0.7825(6) 0.127(4) Uiso 1 1 d D . .
H50A H 0.5985 0.1992 0.7600 0.191 Uiso 1 1 calc R . .
H50B H 0.5111 0.2320 0.7590 0.191 Uiso 1 1 calc R . .
H50C H 0.5525 0.2032 0.8224 0.191 Uiso 1 1 calc R . .
C51 C 0.5835(7) 0.3373(8) 0.7916(7) 0.164(5) Uiso 1 1 d D . .
H51A H 0.5648 0.3595 0.8317 0.197 Uiso 1 1 calc R . .
H51B H 0.5582 0.3772 0.7595 0.197 Uiso 1 1 calc R . .
C52 C 0.6678(6) 0.3558(7) 0.7900(6) 0.132(4) Uiso 1 1 d D . .
H52A H 0.6864 0.3410 0.7486 0.159 Uiso 1 1 calc R . .
H52B H 0.6944 0.3126 0.8196 0.159 Uiso 1 1 calc R . .
C53 C 0.6863(7) 0.4618(8) 0.8060(6) 0.147(5) Uiso 1 1 d D . .
H53A H 0.6639 0.5061 0.7749 0.177 Uiso 1 1 calc R . .
H53B H 0.6665 0.4790 0.8466 0.177 Uiso 1 1 calc R . .
C54 C 0.7722(7) 0.4672(9) 0.8063(7) 0.157(5) Uiso 1 1 d D . .
H54A H 0.7931 0.4499 0.7661 0.189 Uiso 1 1 calc R . .
H54B H 0.7956 0.4258 0.8386 0.189 Uiso 1 1 calc R . .
C55 C 0.7823(10) 0.5741(9) 0.8205(8) 0.194(7) Uiso 1 1 d D . .
H55A H 0.7745 0.6118 0.7829 0.291 Uiso 1 1 calc R . .
H55B H 0.8339 0.5854 0.8370 0.291 Uiso 1 1 calc R . .
H55C H 0.7451 0.5939 0.8508 0.291 Uiso 1 1 calc R . .
C56 C 1.0200(9) 0.3110(9) 1.0788(7) 0.176(6) Uiso 1 1 d D . .
H56A H 0.9655 0.2957 1.0795 0.264 Uiso 1 1 calc R . .
H56B H 1.0426 0.3017 1.1198 0.264 Uiso 1 1 calc R . .
H56C H 1.0450 0.2682 1.0497 0.264 Uiso 1 1 calc R . .
C57 C 1.0301(8) 0.4125(9) 1.0597(6) 0.153(5) Uiso 1 1 d D . .
H57A H 1.0855 0.4247 1.0575 0.184 Uiso 1 1 calc R . .
H57B H 1.0106 0.4540 1.0928 0.184 Uiso 1 1 calc R . .
C58 C 0.9945(8) 0.4463(3) 1.0011(6) 0.142(5) Uiso 1 1 d D . .
H58A H 0.9396 0.4302 0.9996 0.170 Uiso 1 1 calc R . .
H58B H 1.0191 0.4151 0.9659 0.170 Uiso 1 1 calc R . .
C8A C 0.9099(11) -0.0285(12) 1.2082(7) 0.057(6) Uiso 0.339(11) 1 d PD B 2
H8A1 H 0.9639 -0.0334 1.2199 0.085 Uiso 0.339(11) 1 calc PR B 2
H8A2 H 0.8906 -0.0925 1.1964 0.085 Uiso 0.339(11) 1 calc PR B 2
H8A3 H 0.8812 -0.0041 1.2429 0.085 Uiso 0.339(11) 1 calc PR B 2
C9A C 0.9556(9) 0.0292(13) 1.1022(6) 0.047(5) Uiso 0.339(11) 1 d PD B 2
H9A1 H 0.9479 0.0833 1.0737 0.071 Uiso 0.339(11) 1 calc PR B 2
H9A2 H 0.9459 -0.0319 1.0807 0.071 Uiso 0.339(11) 1 calc PR B 2
H9A3 H 1.0082 0.0300 1.1182 0.071 Uiso 0.339(11) 1 calc PR B 2
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Sn Sn -0.6537 1.4246 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_3
N1 Sn1 C45 89.39(14) .
N1 Sn1 Sn1 105.76(10) 3_657
C45 Sn1 Sn1 92.23(12) 3_657
N1 Si1 C36 110.69(19) .
N1 Si1 C42 111.41(19) .
C36 Si1 C42 108.7(2) .
N1 Si1 C39 106.23(18) .
C36 Si1 C39 110.0(2) .
C42 Si1 C39 109.71(19) .
C1 N1 Si1 125.8(3) .
C1 N1 Sn1 115.4(3) .
Si1 N1 Sn1 117.51(17) .
C6 C1 C2 116.5(4) .
C6 C1 N1 122.0(4) .
C2 C1 N1 121.5(4) .
C45 N2 C46 178.7(4) .
C3 C2 C1 120.3(4) .
C3 C2 C10 116.9(4) .
C1 C2 C10 122.8(4) .
C4 C3 C2 123.2(4) .
C3 C4 C5 116.4(4) .
C3 C4 C7 121.1(4) .
C5 C4 C7 122.6(5) .
C6 C5 C4 123.0(5) .
C5 C6 C1 120.5(4) .
C5 C6 C23 117.1(4) .
C1 C6 C23 122.4(4) .
C9 C7 C8A 119.9(10) .
C9 C7 C4 117.7(6) .
C8A C7 C4 121.4(9) .
C9 C7 C8 117.3(7) .
C8A C7 C8 47.2(8) .
C4 C7 C8 111.5(5) .
C9 C7 C9A 45.7(8) .
C8A C7 C9A 118.1(11) .
C4 C7 C9A 109.0(8) .
C8 C7 C9A 83.6(8) .
C2 C10 C17 113.7(4) .
C2 C10 C11 111.6(4) .
C17 C10 C11 110.1(4) .
C16 C11 C12 118.1(4) .
C16 C11 C10 122.3(4) .
C12 C11 C10 119.6(4) .
C13 C12 C11 120.7(4) .
C12 C13 C14 120.4(5) .
C15 C14 C13 119.3(5) .
C14 C15 C16 120.1(5) .
C11 C16 C15 121.4(5) .
C18 C17 C22 118.0(6) .
C18 C17 C10 119.3(6) .
C22 C17 C10 122.7(5) .
C17 C18 C19 120.2(7) .
C20 C19 C18 120.6(7) .
C21 C20 C19 119.3(7) .
C20 C21 C22 120.7(8) .
C17 C22 C21 121.2(7) .
C30 C23 C6 113.0(4) .
C30 C23 C24 109.3(4) .
C6 C23 C24 114.2(4) .
C25 C24 C29 118.0(4) .
C25 C24 C23 124.5(4) .
C29 C24 C23 117.5(4) .
C24 C25 C26 120.6(5) .
C27 C26 C25 120.3(5) .
C28 C27 C26 119.6(5) .
C27 C28 C29 120.4(5) .
C28 C29 C24 121.1(5) .
C35 C30 C31 117.5(5) .
C35 C30 C23 120.0(4) .
C31 C30 C23 122.5(5) .
C30 C31 C32 121.3(6) .
C33 C32 C31 120.0(6) .
C32 C33 C34 119.5(6) .
C35 C34 C33 120.1(6) .
C30 C35 C34 121.5(5) .
C37 C36 C38 109.7(4) .
C37 C36 Si1 119.8(3) .
C38 C36 Si1 111.8(3) .
C40 C39 C41 110.4(4) .
C40 C39 Si1 114.4(3) .
C41 C39 Si1 112.3(3) .
C43 C42 C44 109.5(4) .
C43 C42 Si1 112.7(3) .
C44 C42 Si1 116.6(3) .
N2 C45 Sn1 164.2(4) .
N2 C46 C49 107.4(5) .
N2 C46 C47 108.9(4) .
C49 C46 C47 112.1(5) .
N2 C46 C48 107.6(4) .
C49 C46 C48 112.4(7) .
C47 C46 C48 108.3(6) .
C50 C51 C52 115.8(10) .
C51 C52 C53 111.2(9) .
C54 C53 C52 104.8(9) .
C53 C54 C55 99.3(11) .
C56 C57 C58 119.4(11) .
C57 C58 C58 106.7(11) 3_767
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Sn1 N1 2.202(3) .
Sn1 C45 2.325(4) .
Sn1 Sn1 3.0759(6) 3_657
Si1 N1 1.746(4) .
Si1 C36 1.881(5) .
Si1 C42 1.897(4) .
Si1 C39 1.911(4) .
N1 C1 1.436(5) .
C1 C6 1.422(6) .
C1 C2 1.427(6) .
N2 C45 1.149(6) .
N2 C46 1.472(6) .
C2 C3 1.394(6) .
C2 C10 1.529(6) .
C3 C4 1.380(7) .
C4 C5 1.395(7) .
C4 C7 1.532(7) .
C5 C6 1.390(6) .
C6 C23 1.538(6) .
C7 C9 1.478(7) .
C7 C8A 1.486(8) .
C7 C8 1.534(6) .
C7 C9A 1.535(8) .
C10 C17 1.529(8) .
C10 C11 1.535(6) .
C11 C16 1.386(6) .
C11 C12 1.393(7) .
C12 C13 1.387(7) .
C13 C14 1.388(7) .
C14 C15 1.378(7) .
C15 C16 1.389(6) .
C17 C18 1.389(8) .
C17 C22 1.391(8) .
C18 C19 1.405(10) .
C19 C20 1.386(12) .
C20 C21 1.357(11) .
C21 C22 1.394(8) .
C23 C30 1.536(7) .
C23 C24 1.540(6) .
C24 C25 1.394(7) .
C24 C29 1.396(6) .
C25 C26 1.396(7) .
C26 C27 1.390(8) .
C27 C28 1.369(8) .
C28 C29 1.393(7) .
C30 C35 1.387(7) .
C30 C31 1.389(7) .
C31 C32 1.402(8) .
C32 C33 1.368(9) .
C33 C34 1.388(9) .
C34 C35 1.387(8) .
C36 C37 1.531(6) .
C36 C38 1.545(6) .
C39 C40 1.539(6) .
C39 C41 1.551(7) .
C42 C43 1.528(6) .
C42 C44 1.543(6) .
C46 C49 1.498(6) .
C46 C47 1.504(6) .
C46 C48 1.520(6) .
C50 C51 1.503(7) .
C51 C52 1.504(7) .
C52 C53 1.539(7) .
C53 C54 1.510(7) .
C54 C55 1.520(7) .
C56 C57 1.476(7) .
C57 C58 1.487(7) .
C58 C58 1.499(8) 3_767
